Compound Detail
CHEMBL69349
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Basic Information
| ChEMBL ID | CHEMBL69349 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | GXEDNWSUKCJLLB-ZCFIWIBFSA-N |
3
Targets
4
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
133.3
MW (Da)
1.29
ALogP
2
HBA
2
HBD
26.0
PSA (Ų)
0.56
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
Ki 4 meas. best 7.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Aminopeptidase N CHEMBL2590 | Ki | 7.7 | 7.7 | 20.0 | 1 |
| Leucine aminopeptidase CHEMBL3763002 | Ki | 7.66 | 7.66 | 22.0 | 1 |
| Aminopeptidase B CHEMBL2452 | Ki | 6.89 | 6.89 | 130.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Aminopeptidase N | Ki | = | 20.0 | nM | 7.7 | Inhibitory activity against Aminopeptidase M | 3184126 |
| Leucine aminopeptidase | Ki | = | 22.0 | nM | 7.66 | Competitive inhibition of LAP in porcine kidney microsomes | 29630364 |
| Aminopeptidase B | Ki | = | 130.0 | nM | 6.89 | Inhibitory activity against aminopeptidase B | 3184126 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 3184126 | 10.1021/jm00119a022 | Aminopeptidase N | 1 |
| 3184126 | 10.1021/jm00119a022 | Cytosol aminopeptidase | 1 |
| 3184126 | 10.1021/jm00119a022 | Aminopeptidase B | 1 |
| 29630364 | 10.1021/acs.jmedchem.7b00782 | Leucine aminopeptidase | 1 |
Data from ChEMBL 36 via Core Engine